ChemSpider 2D Image | (2R)-3-(4'-Fluoro-4-biphenylyl)-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid (non-preferred name) | C20H22FNO4

(2R)-3-(4'-Fluoro-4-biphenylyl)-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid (non-preferred name)

  • Molecular FormulaC20H22FNO4
  • Average mass359.391 Da
  • Monoisotopic mass359.153290 Da
  • ChemSpider ID38237334

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R)-3-(4'-Fluor-4-biphenylyl)-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propansäure (non-preferred name) [German] [ACD/IUPAC Name]
(2R)-3-(4'-Fluoro-4-biphenylyl)-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid (non-preferred name) [ACD/IUPAC Name]
Acide (2R)-3-(4'-fluoro-4-biphénylyl)-2-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)propanoïque (non-preferred name) [French] [ACD/IUPAC Name]
(2R)-2-[(tert-butoxycarbonyl)amino]-3-{4'-fluoro-[1,1'-biphenyl]-4-yl}propanoic acid
(2R)-2-{[(tert-butoxy)carbonyl]amino}-3-{4'-fluoro-[1,1'-biphenyl]-4-yl}propanoic acid
(R)-2-((tert-Butoxycarbonyl)amino)-3-(4'-fluoro-[1,1'-biphenyl]-4-yl)propanoic acid
(r)-2-(boc-amino)-3-(4`-fluoro-[1,1`-biphenyl]-4-yl)propanoic acid
(r)-2-(boc-amino)-3-(4-fluoro-[1,1-biphenyl]-4-yl)propanoic acid
(R)-2-(BOC-AMINO)-3-(4'-FLUORO-[1,1'-BIPHENYL]-4-YL)PROPANOIC ACID
1803077-47-5 [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 526.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.3±3.0 kJ/mol
    Flash Point: 272.1±30.1 °C
    Index of Refraction: 1.550
    Molar Refractivity: 95.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.65
    ACD/LogD (pH 5.5): 1.97
    ACD/BCF (pH 5.5): 5.87
    ACD/KOC (pH 5.5): 31.60
    ACD/LogD (pH 7.4): 0.50
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.07
    Polar Surface Area: 76 Å2
    Polarizability: 37.7±0.5 10-24cm3
    Surface Tension: 44.5±3.0 dyne/cm
    Molar Volume: 298.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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